Geometry & MOs

Info

ID:	390982
PubChem CID:	135001990
Reduced:	NO2C29H29 (1)
Stoich.:	AB2C29D29 (1)
Weight, g/mol:	391.982114
ΔH_f, kcal/mol:	23.48
Dipole, Da:	0.83
IP(EA), eV:	-8.18(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-chloro-2-(3-nitrophenyl)-1,3-thiazol-4-yl]-diethoxy-sulfanylidene-lambda5-phosphane

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@@H]2[C@@H](C3=C([C@@H]4[C@H]3OCC4)C5=CC=CC=C5N2CC6=CC=CC=C6)OC

DOS

IR

Vibrations